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Key Documents

C28006

Sigma-Aldrich

(4-Chlorophenyl)acetonitrile

96%

Synonym(s):

4-Chlorobenzyl cyanide

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About This Item

Linear Formula:
ClC6H4CH2CN
CAS Number:
Molecular Weight:
151.59
Beilstein:
971171
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

96%

form

solid (or Semi-Solid or Liquid)

bp

265-267 °C (lit.)

mp

25-28 °C (lit.)

density

1.19 g/mL at 20 °C (lit.)

SMILES string

Clc1ccc(CC#N)cc1

InChI

1S/C8H6ClN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5H2

InChI key

IVYMIRMKXZAHRV-UHFFFAOYSA-N

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Pictograms

Skull and crossbones

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 2 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

6.1A - Combustible, acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 3

Flash Point(F)

271.4 °F

Flash Point(C)

133 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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